0 B10R2.7 C1=CC2=C(C=C1)SC=N2 R587656 [0,0,0,0,0,0|4,0,0]=4 1 B10R2.7 C1=CC2=C(C=C1)[Se]C=N2 S440051 [0,0,0,0,0,0|4,0,0]=4 2 B10R2.7 C1=CC2=C(C=CN2)C=N1 PH010447 [0,0,0,0,0,0|2,0,1]=3 3 B10R2.7 C1=CC2=C(C=N1)C=NN2 BLN00013 [0,0,0,0,0,0|1,0,1]=2 4 B10R2.7 C1=CC2=C(C=N1)NC=C2 CDS007514 [0,0,0,0,0,0|4,0,0]=4 5 B10R2.7 C1=CC2=C(C=N1)NN=C2 BLN00001 [0,0,0,0,0,0|3,0,0]=3 6 B10R2.7 C1=CC2=CC=NC=C2O1 SYX00443 [0,0,0,0,0,0|4,0,0]=4 7 B10R2.7 C1=CC2=NC=NN2C=C1 SYX00359 [0,0,0,0,0,0|3,0,0]=3 8 B10R2.7 C1=CN2C=CN=C2N=C1 CDS017059 [0,0,0,0,0,0|3,0,0]=3 9 B10R2.7 C1=CN=C2C=NNC2=C1 BLN00003 [0,0,0,0,0,0|3,0,1]=4 10 B10R2.7 C1=NN=C2N1CCCC2 CBR01413 [0,0,0,0,0,0|1,0,3]=4 11 B10R2.7 C1=NN=C2N1CCNC2 CDS019461 [0,0,0,0,0,0|2,0,2]=4 12 B11R2.1 BrC1=NNC2=C1C=NC=C2 BLN00011 [0,1,0,0,0,0|1,0,1]=3 13 B11R2.1 BrC1=NNC2=CN=CC=C12 BLN00004 [0,1,0,0,0,0|3,0,0]=4 14 B11R2.1 CC1=CN=C2N1C=CC=C2 SYX00420 [0,1,0,0,0,0|2,0,0]=3 15 B11R2.1 CC1=NNC2=CC=CC=C12 CDS006326 [0,1,0,0,0,0|2,0,1]=4 16 B11R2.1 CC1=NOC2=C1C=CC=C2 T328049 [0,1,0,0,0,0|3,0,0]=4 17 B11R2.1 ClC1=NNC2=C1C=CN=C2 BLN00007 [0,1,0,0,0,0|3,0,0]=4 18 B11R2.1 ClC1=NOC2=C1C=CC=C2 PH002974 [0,1,0,0,0,0|3,0,0]=4 19 B11R2.1 ClC1=NSC2=CC=CC=C12 PH000260 [0,1,0,0,0,0|3,0,0]=4 20 B11R2.1 ClC1=NSC2=CC=CC=C12 PH000929 [0,1,0,0,0,0|3,0,0]=4 21 B11R2.1 NC1=NNC2=C1C=CC=C2 CDS014250 [0,1,0,0,0,0|2,0,1]=4 22 B11R2.1 NC1=NNC2=CN=CC=C12 BLN00042 [0,1,0,0,0,0|3,0,0]=4 23 B11R2.1 NC1=NOC2=C1C=CC=C2 CDS013958 [0,1,0,0,0,0|3,0,0]=4 24 B11R2.36 BrC1=CC2=C(C=C1)NN=N2 CDS007659 [0,1,0,0,0,0|3,0,0]=4 25 B11R2.36 BrC1=CC2=C(C=NN2)C=N1 BLN00019 [0,1,0,0,0,0|1,0,1]=3 26 B11R2.36 BrC1=CC2=NC=CN2C=C1 SYX00066 [0,1,0,0,0,0|2,0,0]=3 27 B11R2.36 BrC1=CC2=NC=NN2C=C1 SYX00403 [0,1,0,0,0,0|3,0,0]=4 28 B11R2.36 BrC1=CN2C=NN=C2C=C1 SYX00142 [0,1,0,0,0,0|1,0,0]=2 29 B11R2.36 BrC1=CN2N=CN=C2C=C1 SYX00141 [0,1,0,0,0,0|3,0,0]=4 30 B11R2.36 CC1=CC2=C(C=C1)NN=N2 CDS000420 [0,1,0,0,0,0|3,0,0]=4 31 B11R2.36 CC1=CC2=C(C=N1)NN=C2 BLN00020 [0,1,0,0,0,0|3,0,0]=4 32 B11R2.36 CC1=CC=C2C=NNC2=C1 CDS009361 [0,1,0,0,0,0|2,0,1]=4 33 B11R2.36 CC1=CC=C2NN=CC2=C1 CBR00090 [0,1,0,0,0,0|2,0,1]=4 34 B11R2.36 ClC1=CC2=C(C=NN2)C=N1 BLN00009 [0,1,0,0,0,0|1,0,1]=3 35 B11R2.36 ClC1=CC=C2C=NNC2=C1 CDS006195 [0,1,0,0,0,0|2,0,1]=4 36 B11R2.36 ClC1=CC=C2NN=CC2=C1 CDS006550 [0,1,0,0,0,0|2,0,1]=4 37 B11R2.36 ClC1=CN2C=CN=C2C=C1 ADE001445 [0,1,0,0,0,0|2,0,0]=3 38 B11R2.36 ClC1=NN2C=CN=C2C=C1 CDS005940 [0,1,0,0,0,0|3,0,0]=4 39 B11R2.36 ClC1=NN2C=NN=C2C=C1 CDS002398 [0,1,0,0,0,0|2,0,0]=3 40 B11R2.36 FC1=CC=C2C=NNC2=C1 CDS006466 [0,1,0,0,0,0|2,0,1]=4 41 B11R2.36 NC1=CC2=C(C=C1)NN=N2 CDS000711 [0,1,0,0,0,0|3,0,0]=4 42 B11R2.36 OC1=NN2C=CN=C2C=C1 SYX00185 [0,1,0,0,0,0|3,0,0]=4 43 B11R2.106 BrC1=C2NN=CC2=CN=C1 BLN00050 [0,1,0,0,0,0|1,0,1]=3 44 B11R2.106 BrC1=C2NN=NC2=CC=C1 CDS021140 [0,1,0,0,0,0|3,0,0]=4 45 B11R2.106 BrC1=CN=CC2=C1C=NN2 BLN00051 [0,1,0,0,0,0|3,0,0]=4 46 B11R2.106 CC1=C2C=NNC2=CC=C1 CBR00232 [0,1,0,0,0,0|2,0,1]=4 47 B11R2.106 CC1=C2NN=CC2=CC=C1 CBR00226 [0,1,0,0,0,0|2,0,1]=4 48 B11R2.106 CC1=CN=CC2=C1NN=C2 BLN00046 [0,1,0,0,0,0|1,0,1]=3 49 B11R2.106 ClC1=CC=CC2=C1C=NN2 BML00245 [0,1,0,0,0,0|2,0,1]=4 50 B11R2.106 ClC1=CC=CC2=NN=CN12 SYX00172 [0,1,0,0,0,0|1,0,0]=2 51 B11R2.106 ClC1=CN=CC2=C1NN=C2 BLN00071 [0,1,0,0,0,0|1,0,1]=3 52 B11R2.106 ClC1=NC=CC2=C1C=CN2 ADE000994 [0,1,0,0,0,0|2,0,1]=4 53 B11R2.106 ClC1=NC=CC2=C1C=NN2 BLN00015 [0,1,0,0,0,0|1,0,1]=3 54 B11R2.106 ClC1=NC=CC2=NC=NN12 SYX00162 [0,1,0,0,0,0|2,0,0]=3 55 B11R2.106 NC1=CC=CC2=NC=CN12 CDS016722 [0,1,0,0,0,0|2,0,0]=3 56 B11R2.106 NC1=NC=NC2=NC=NN12 CBR01464 [0,1,0,0,0,0|3,0,0]=4 57 B11R2.106 OC1=NC=CC2=C1C=CO2 CVT00122 [0,1,0,0,0,0|3,0,0]=4 58 B11R2.106 OC1=NC=CC2=NC=NN12 SYX00161 [0,1,0,0,0,0|2,0,0]=3 59 B9R1.8 C(=N/O)\C1=CC=CC=C1 S893145 [0,0,1,0,0,0|3,0,0]=4 60 B9R1.15 NC1=C(C=NC=C1)C=O ADE000099 [0,0,1,0,0,0|2,0,1]=4 61 B11R2.20 C1=CC2=C(C=C1)C=NC=C2 R702455 [0,0,0,0,0,1|3,0,0]=4 62 B11R2.20 C1=CC2=CN=CC=C2N=C1 ADE000839 [0,0,0,0,0,1|2,0,0]=3 63 B11R2.20 C1=CC2=[N+](C=C1)C=CC=N2 S29867 [0,0,0,0,0,1|2,0,1]=4 64 B8R1.11 C=CN1C=CN=C1C S463205 [1,0,1,0,0,0|1,0,1]=4 65 B10R1.4 NC1=NC=CC=C1/C=N/O ADE000280 [0,1,1,0,0,0|2,0,0]=4 66 B10R1.4 O/N=C/C1=C(C=CN=C1)Cl ADE000661 [0,1,1,0,0,0|2,0,0]=4 67 B10R1.15 C/C(=N\O)/C1=CN=CC=C1 PH005162 [0,1,1,0,0,0|2,0,0]=4 68 B12R2.24 CC1=NC2=C(C=C1)C=NC=C2 PH008439 [0,1,0,0,0,1|2,0,0]=4 69 B12R2.24 ClC1=NC2=C(C=CC=C2)C=N1 UPL0037 [0,1,0,0,0,1|2,0,0]=4 70 B12R2.24 NC1=CC=C2C=NC=CC2=N1 CDS006673 [0,1,0,0,0,1|2,0,0]=4 71 B12R2.24 NC1=NC=C2C=CC=CC2=N1 CDS008332 [0,1,0,0,0,1|2,0,0]=4 72 B12R2.1081 BrC1=CC=CC2=CN=NC=C12 CDS021144 [0,1,0,0,0,1|2,0,0]=4 73 B12R2.1081 ClC1=CC=NC2=C1C=NC=C2 CDS023178 [0,1,0,0,0,1|2,0,0]=4 74 B12R2.1081 NC1=C2C=CC=CC2=NC=N1 CBR00181 [0,1,0,0,0,1|2,0,0]=4 75 B12R2.132 ClC1=CN2C(=CN=C2C=C1)Br ANV00107 [0,2,0,0,0,0|2,0,0]=4 76 B12R2.132 SC1=NN=C2N1C=C(C=C2)Br SYX00411 [0,2,0,0,0,0|1,0,0]=3 77 B12R2.196 BrC1=CN=CC2=C1NN=C2Br BLN00059 [0,2,0,0,0,0|1,0,1]=4 78 B12R2.196 BrC1=CN=CC2=C1NN=C2I BLN00062 [0,2,0,0,0,0|1,0,1]=4 79 B12R2.196 CC1=NN=C2N1C=CC=C2Cl SYX00143 [0,2,0,0,0,0|1,0,0]=3 80 B12R2.196 ClC1=CN=CC2=C1NN=C2Br BLN00026 [0,2,0,0,0,0|1,0,1]=4 81 B12R2.196 ClC1=CN=CC2=C1NN=C2I BLN00029 [0,2,0,0,0,0|1,0,1]=4 82 B12R2.196 NC1=CC=CN2C1=NC=C2Br CDS024219 [0,2,0,0,0,0|2,0,0]=4 83 B12R2.203 BrC1=NC=CC2=C1C(=NN2)Br BLN00061 [0,2,0,0,0,0|1,0,1]=4 84 B12R2.203 BrC1=NC=CC2=C1C(=NN2)I BLN00064 [0,2,0,0,0,0|1,0,1]=4 85 B12R2.203 CC1=CN=C2N1C(=CC=C2)N SYX00144 [0,2,0,0,0,0|2,0,0]=4 86 B12R2.203 ClC1=NC=CC2=C1C(=NN2)Br BLN00028 [0,2,0,0,0,0|1,0,1]=4 87 B12R2.203 ClC1=NC=CC2=C1C(=NN2)I BLN00018 [0,2,0,0,0,0|1,0,1]=4 88 B12R2.612 BrC1=CC2=C(C=N1)C(=NN2)Br BLN00060 [0,2,0,0,0,0|1,0,1]=4 89 B12R2.612 BrC1=CC2=C(C=N1)C(=NN2)I BLN00063 [0,2,0,0,0,0|1,0,1]=4 90 B12R2.612 CC1=NC2=NN=C(N2C=C1)N CBR01648 [0,2,0,0,0,0|2,0,0]=4 91 B12R2.612 ClC1=NC=C2C(=C1)NN=C2I BLN00030 [0,2,0,0,0,0|1,0,1]=4 92 B12R2.32 ClCC1=CN2C=CC=CC2=N1 T328316 [0,2,0,0,0,0|2,0,0]=4 93 B12R2.32 NCC1=CN2C=CC=CC2=N1 CBR00989 [0,2,0,0,0,0|2,0,0]=4 94 B12R2.32 OCC1=CN2C=CC=CC2=N1 CDS017742 [0,2,0,0,0,0|2,0,0]=4 95 B12R2.32 OCC1=CN2C=CC=CC2=N1 SYX00380 [0,2,0,0,0,0|2,0,0]=4 96 B12R2.202 CC1=CN2C(=CC=CC2=N1)N CBR02342 [0,2,0,0,0,0|2,0,0]=4 97 B12R2.44 C(=O)C1=CN2C=CN=C2C=C1 CDS016444 [0,2,0,0,0,0|2,0,0]=4 98 B12R2.44 NNC1=NN2C=NN=C2C=C1 CBR00723 [0,2,0,0,0,0|2,0,0]=4 99 B12R2.44 OCC1=CN2C=CN=C2C=C1 CDS018509 [0,2,0,0,0,0|2,0,0]=4 100 B12R2.246 BrC1=CN2C=CN=C2C(=C1)I ADE001431 [0,2,0,0,0,0|2,0,0]=4 101 B12R2.246 CC1=CC(=CN2C1=NC=C2)Br CBR02032 [0,2,0,0,0,0|2,0,0]=4 102 B12R2.246 CC1=CN2C=CN=C2C(=C1)I ADE001436 [0,2,0,0,0,0|2,0,0]=4 103 B13R2.430 O=C(O)C1=CN2C=NN=C2C=C1 CDS020238 [0,3,0,0,0,0|1,0,0]=4 104 B13R2.5569 O=C(O)C1=CC=CN2C1=NN=C2 CBR02428 [0,3,0,0,0,0|1,0,0]=4